SCHEMBL742499

SCHEMBL742499

O=[Cr](=O)([O-])Cl.O=[Cr](=O)([O-])Cl.c1cc[n+](-c2cccc[nH+]2)cc1

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ RAB9A P51151 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL3497533 0.85 NPC1 (0.32) NPC1MAPTRAB9A
SCHEMBL6559586 0.85 NPC1 (0.32) NPC1MAPTRAB9A
SCHEMBL7907971 0.85 NPC1 (0.32) NPC1MAPTRAB9A
SCHEMBL3462672 0.85 NPC1 (0.32) NPC1MAPTRAB9A
Hydrochloric Acid SCHEMBL3810895 0.83 NPC1 (0.32) NPC1MAPTRAB9A
SCHEMBL3351116 0.79 ACHE (0.32) NPC1MAPTRAB9A
Dipyridyl SCHEMBL864108 0.70 — —
SCHEMBL5056899 0.67 — —
SCHEMBL742500 0.64 — —
Pyridine SCHEMBL204 0.61 — —

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010058235-A1 METHOD FOR THE PREPARATION OF OXYCAROTENOIDS INNOVA ANDINA S.A. (PE) 2010-05-27 — — WO claimed
EP-2429991-A1 REDOX DRUG DERIVATIVES Redx Pharma Limited (GB) 2012-03-21 — — EP disclosed
WO-2010131054-A1 REDOX DRUG DERIVATIVES BRADFORD PHARMA LIMITED (GB) 2010-11-18 — — WO disclosed
WO-2010058235-A1 METHOD FOR THE PREPARATION OF OXYCAROTENOIDS INNOVA ANDINA S.A. (PE) 2010-05-27 — — WO disclosed
US-5026855-A Hypotensive agents, diuretics SOCIETE DE CONSELS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES (FR) 1991-06-25 — — US disclosed
EP-0152429-B1 PROGESTATIONALLY ACTIVE STEROIDS RESEARCH TRIANGLE INSTITUTE (US) 1989-10-11 — — EP disclosed
EP-0152429-A4 PROGESTATIONALLY ACTIVE STEROIDS. RES TRIANGLE INST (US) 1985-12-05 — — EP disclosed
EP-0152429-A1 PROGESTATIONALLY ACTIVE STEROIDS. RES TRIANGLE INST (US) 1985-08-28 — — EP disclosed
US-4512986-A FERTILITY CONTROL RESEARCH TRIANGLE INSTITUTE (US) 1985-04-23 — — US disclosed
WO-1985000609-A1 PROGESTATIONALLY ACTIVE STEROIDS RESEARCH TRIANGLE INSTITUTE (US) 1985-02-14 — — WO disclosed
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